| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2009 | 16 | Yes |
Popular Name: 1-benzyl-3-[(methylamino)methyl]pyrrolidin-3-ol 1-benzyl-3-[(methylamino)methyl]…
Find On: PubMed — Wikipedia — Google
CAS Number: 125033-63-8
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.08 | 2.84 | -34.55 | 3 | 3 | 1 | 37 | 221.324 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.08 | 1.87 | -42.48 | 3 | 3 | 1 | 40 | 221.324 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.08 | 4.32 | -103.9 | 4 | 3 | 2 | 41 | 222.332 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0326916A2; US5173484; US5284842; US5453422 | IBM Patent Data |
